RefChem:73084

trisodium;2-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)amino]-5-[[3-methyl-5-oxo-1-(4-sulfonatophenyl)-4H-pyrazol-4-yl]diazenyl]benzene-1,4-disulfonate

Also Known As: 6-Amino-1.2.3-benzothiadiazol|1,4-Benzenedisulfonic acid, 2-((4-chloro-6-methoxy-1,3,5-triazin-2-yl)amino)-5-((4,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-1H-pyrazol-4-yl)azo)-, trisodium salt|1,4-Benzenedisulfonic acid, 2-((4-chloro-6-methoxy-1,3,5-triazin-2-yl)amino)-5-(2-(4,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-1H-pyrazol-4-yl)diazenyl)-, sodium salt (1:3)|2-((4-Chloro-6-methoxy-1,3,5-triazin-2-yl)amino)-5-((4,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-1H-pyrazol-4-yl)azo)-1,4-benzenedisulfonic acid, trisodium salt|1,4-Benzenedisulfonic acid, 2-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)amino]-5-[[4,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-1H-pyrazol-4-yl]azo]-, trisodium salt|1,4-Benzenedisulfonic acid, 2-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)amino]-5-[2-[4,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-1H-pyrazol-4-yl]diazenyl]-, sodium salt (1:3)|1,4-Benzenedisulfonic acid, 2-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)amino]-5-[[4,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-1H-pyrazol-4-yl]azo]-|2-((4-Chloro-6-methoxy-1,3,5-triazin-2-yl)amino)-5-((4,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-1H-pyrazol-4-yl)azo)-1,4-benzenedisulfonic acid,trisodium salt|2-[(4-Chloro-6-methoxy-1,3,5-triazin-2-yl)amino]-5-[[[4,5-dihydro-3-methyl-5-oxo-1-[4-(sodiooxysulfonyl)phenyl]-1H-pyrazol]-4-yl]azo]-1,4-benzenedisulfonic acid disodium salt|Trisodium 2-((4-chloro-6-methoxy-1,3,5-triazin-2-yl)amino)-5-((4,5-dihydro-3-methyl-5-oxo-1-(4-sulphonatophenyl)-1H-pyrazol-4-yl)azo)benzene-1,4-disulphonate|trisodium 2-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)amino]-5-[[3-methyl-5-oxo-1-(4-sulfonatophenyl)-4H-pyrazol-4-yl]diazenyl]benzene-1,4-disulfonate|Trisodium 2-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)amino]-5-[[4,5-dihydro-3-methyl-5-oxo-1-(4-sulphonatophenyl)-1H-pyrazol-4-yl]azo]benzene-1,4-disulphonate|Trisodium 2-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)amino]-5-{[3-methyl-5-oxo-1-(4-sulfonatophenyl)-4,5-dihydro-1H-pyrazol-4-yl]diazenyl}benzene-1,4-disulfonate|trisodium,2-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)amino]-5-[[3-methyl-5-oxo-1-(4-sulfonatophenyl)-4H-pyrazol-4-yl]diazenyl]benzene-1,4-disulfonate

Molecular Formula	C20H14ClN8Na3O11S3
Molecular Weight	741.93256 g/mol
LogP	-8.1235
Topological Polar Surface Area	314.0 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	18
Rotatable Bonds	6
Exact Mass	741.93256
Monoisotopic Mass	741.93256
Heavy Atoms	46
Complexity	1380.0

Chemical Identifiers

CAS Number	41973-82-4
SMILES	CC1=NN(C(=O)C1N=NC2=C(C=C(C(=C2)S(=O)(=O)[O-])NC3=NC(=NC(=N3)Cl)OC)S(=O)(=O)[O-])C4=CC=C(C=C4)S(=O)(=O)[O-].[Na+].[Na+].[Na+]
InChIKey	AGFKGCBQQDZVOK-UHFFFAOYSA-K